CID 271647

7-hydroxy-4-methyl-2h-benzo[h]chromen-2-one

Structural Information

Molecular Formula

C₁₄H₁₀O₃

SMILES

CC1=CC(=O)OC2=C1C=CC3=C2C=CC=C3O

InChI

InChI=1S/C14H10O3/c1-8-7-13(16)17-14-9(8)5-6-10-11(14)3-2-4-12(10)15/h2-7,15H,1H3

InChIKey

ICQJMFFQTDQTNL-UHFFFAOYSA-N

Compound name

7-hydroxy-4-methylbenzo[h]chromen-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2
Patents: 226.06299 Da
Monoisotopic Mass: 2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	227.07027	144.2
[M+Na]+	249.05221	162.2
[M+NH4]+	244.09681	154.0
[M+K]+	265.02615	154.4
[M-H]-	225.05571	149.6
[M+Na-2H]-	247.03766	152.3
[M]+	226.06244	148.6
[M]-	226.06354	148.6

Literature stripe

literature stripe

Patent stripe

patents stripe